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	hartrees
Energy at 0K	-155.704444
Energy at 298.15K	-155.707096
HF Energy	-155.704444
Nuclear repulsion energy	35.486840

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3302	3254	2.91
2	A'	1576	1554	27.72
3	A'	1241	1223	68.51
4	A'	870	857	32.80
5	A"	3411	3362	0.16
6	A"	1292	1273	0.57

Atom	x (Å)	y (Å)	z (Å)
N1	-0.066	0.703	0.000
F2	-0.066	-0.746	0.000
H3	0.530	0.898	0.813
H4	0.530	0.898	-0.813

	N1	F2	H3	H4
N1		1.4488	1.0270	1.0270
F2	1.4488		1.9290	1.9290
H3	1.0270	1.9290		1.6264
H4	1.0270	1.9290	1.6264

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	N1	H3	100.988		F2	N1	H4	100.988
H3	N1	H4	104.708

All results from a given calculation for NH₂F (monofluoroamine)

using model chemistry: B97D3/TZVP

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	N	-0.203
2	F	-0.223
3	H	0.213
4	H	0.213

	x	y	z	Total
	1.958	1.539	0.000	2.490
CHELPG
AIM
ESP

	x	y	z
x	1.422	0.179	0.000
y	0.179	2.098	0.000
z	0.000	0.000	1.667

<r²>	18.988
(<r²>)^1/2	4.357

All results from a given calculation for NH2F (monofluoroamine)

using model chemistry: B97D3/TZVP

States and conformations

All results from a given calculation for NH₂F (monofluoroamine)